4,4-dimethyl-2-(4-methylphenyl)carbonyl-pyrazol-3-one

Systemtic Name: 4,4-dimethyl-2-(4-methylphenyl)carbonyl-pyrazol-3-one Openeye Name: 4,4-dimethyl-2-(4-methylbenzoyl)pyrazol-3-one CAS Name: 4,4-dimethyl-2-[(4-methylphenyl)-oxomethyl]-3-pyrazolone IUPAC Name: 4,4-dimethyl-2-(4-methylbenzoyl)pyrazol-3-one Traditional Name: 4,4-dimethyl-2-p-toluoyl-2-pyrazolin-3-one Formula: C13H14N2O2 MolecularWeight: 230.26246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(=O)C(C=N2)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(=O)C(C=N2)(C)C

InChI

InChI=1S/C13H14N2O2/c1-9-4-6-10(7-5-9)11(16)15-12(17)13(2,3)8-14-15/h4-8H,1-3H3